Information card for entry 7110726

Structure parameters

• Formula: C6 H34 Al3 Cl Li2 O25 P6
• Calculated formula: C6 H18 Al3 Cl Li2 O25 P6
• Title of publication: Synthesis and structure of Li2Al3(HO3PMe)2(O3PMe)4Cl·7H2O,an ionic, layered lithium aluminium methylphosphonate
• Authors of publication: Hix, Gary B.; Wragg, David S.; Bull, Ivor; Morris, Russell E.; Wright, Paul A.
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 23
• Pages of publication: 2421
• a: 10.122 ± 0.0003 Å
• b: 9.4659 ± 0.0002 Å
• c: 15.7849 Å
• α: 90°
• β: 95.805 ± 0.001°
• γ: 90°
• Cell volume: 1504.66 ± 0.05 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0552
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1368
• Weighted residual factors for all reflections included in the refinement: 0.1379
• Goodness-of-fit parameter for all reflections included in the refinement: 0.675
• Diffraction radiation wavelength: 0.6894 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No